input word = C00034023

Metabolite InformationStructural formula
Name Lanceocrepidiaside C
(+)-Lanceocrepidiaside C
Formula C29H34O11
Mw 558.21011193
CAS RN 851779-94-7
C_ID C00034023 ,
InChIKey PRXFRJSACUUPLU-KUQYECBZNA-N
InChICode InChI=1S/C29H34O11/c1-13-18-8-5-16(12-37-22(32)9-15-3-6-17(31)7-4-15)23(18)27-19(14(2)28(36)40-27)10-20(13)38-29-26(35)25(34)24(33)21(11-30)39-29/h3-7,19-21,23-27,29-31,33-35H,2,8-12H2,1H3/t19-,20+,21+,23-,24+,25-,26+,27-,29+/m0/s1
SMILES [C@H]12C(=C([C@@H](C[C@@H]3[C@@H]1OC(=O)C3=C)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C)CC=C2COC(=O)Cc1ccc(cc1)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAsteraceaeCrepidiastrum lanceolatum NAKAI Ref.
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OrganismCrepidiastrum lanceolatum NAKAI
ReferenceZidorn,Phytochem.,69,(2008),2270